EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H30FN3O6S |
| Net Charge | 0 |
| Average Mass | 459.540 |
| Monoisotopic Mass | 459.18393 |
| SMILES | O=C(CN1CCOCC1)N[C@H]1CC[C@H](CCNS(=O)(=O)c2ccccc2F)O[C@@H]1CO |
| InChI | InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17+,18-/m1/s1 |
| InChIKey | OCKURQXTXDTUJZ-BPQIPLTHSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2S,3S,6R)-6-[2-[(2-fluorophenyl)sulfonylamino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-(4-morpholinyl)acetamide (CHEBI:118096) is a amino acid amide (CHEBI:22475) |
| Manual Xrefs | Databases |
|---|---|
| LSM-29545 | LINCS |